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13-ACETOXY-3-BETA-(3-METHYLBUTANOYL)-GERMACRA-1(10)E,4E,7(11)-TRIEN-12,6-ALPHA-OLIDE
SpectraBase Compound ID F5gTxnIeYNN
InChI InChI=1S/C22H30O6/c1-13(2)10-21(24)27-19-9-7-14(3)6-8-17-18(12-26-16(5)23)22(25)28-20(17)11-15(19)4/h7,11,13,19-20H,6,8-10,12H2,1-5H3/b14-7+,15-11+/t19-,20+/m0/s1
InChIKey DGDGNNWGTKTTKN-KWTOUDHNSA-N
Mol Weight 390.48 g/mol
Molecular Formula C22H30O6
Exact Mass 390.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1axSiGbr03V
Name 13-ACETOXY-3-BETA-(3-METHYLBUTANOYL)-GERMACRA-1(10)E,4E,7(11)-TRIEN-12,6-ALPHA-OLIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O6
InChI InChI=1S/C22H30O6/c1-13(2)10-21(24)27-19-9-7-14(3)6-8-17-18(12-26-16(5)23)22(25)28-20(17)11-15(19)4/h7,11,13,19-20H,6,8-10,12H2,1-5H3/b14-7+,15-11+/t19-,20+/m0/s1
InChIKey DGDGNNWGTKTTKN-KWTOUDHNSA-N
Literature Reference Author H.F.WONG,G.D.BROWN
Literature Reference Citation PHYTOCHEM.,59,529(2002)
Literature Reference DOI 10.1016/S0031-9422(01)00479-4
Molecular Weight 390.477 g/mol
Solvent Unknown
Source File Reference UWVN2703